4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-1-pyridin-4-ylethylideneamino]benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-1-pyridin-4-ylethylideneamino]benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-1-(4-pyridyl)ethylideneamino]benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[(E)-1-pyridin-4-ylethylideneamino]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-1-pyridin-4-ylethylideneamino]benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[(E)-1-(4-pyridyl)ethylideneamino]benzamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl)C3=CC=NC=C3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl)/C3=CC=NC=C3

InChI

InChI=1S/C21H18ClN3OS/c1-15(17-10-12-23-13-11-17)24-25-21(26)18-4-2-16(3-5-18)14-27-20-8-6-19(22)7-9-20/h2-13H,14H2,1H3,(H,25,26)/b24-15+